Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequenceMLVTMENYQIIESIGEGSFGKVYKARIKGTGQIVAMKFIVKKGKNEKELKNLRSEIEILTKLNHPHIIMLFDSFETDSDFVVVME-YAQGELYDILEDEKQLPAKEVQKIAKQLIQALNYLHSNRIIHRDMKPQNILI---GQNGAVKLADFGFARSMSYNTIVLTSIKGTPLYMAPELVQERAYDNRVDLWSLGCILYELYYGKPPFYTNNLFALIKKIVCEPVKYDSKANDPISPEFKSFLSGLLTKSASSRLNWPELLNHPFVQLTKSDASWQDAIMQHDSRMKARMDRLGCLRLHGNAGRAAPKRKSTQSDDIFNLKTVQKLTSGCEFDVCATLTQLVRMARASNGDVTKSTALLGVFDSGVLEAALTLLNEKQSVKVVGLVLQFVQELVFPEHGDLLAFPSQRPKRDGLAVLEEKHSRQQEDLFIRQQVALKLMKKPHTALDFIISEISSGGDSLAETCVKIMFQCFRWENSFGPMVTQLRTFPEMWAAILKSVNHHSVSRGETSHEYAALVFHTVSIVIPHVKLASPQRINREEVLELVTQGLSAVCYYEAGMVDAHRNKTPPLVYAAAAALLIAFAHRELKDIVSFKVNGALLDGIYSIVDAVTDAPSRPVTPRALGSSYGYPDYGLLDGVAHMLSLVFSDSDSLVYAKLPGRSEHRFLESDTKSLALLVMTLLRDSDPRMELSPNGVQTLLRAAQQIFQQEKEQALSMSLLMEPIAPYSGESGSLCWLSVICRTMKTDYFRQLFYWPACRGGGATGVSAHVTIVSQILSDSLRPVSSSSNPTPVEDKLLGDVSRVLYKEKVIELLVHAMDYSEGVFLGSPFAIIAKLCANSADSIKAFVDCGGVDAARIRRILDPDKAGTGLMSDGLVVLSQMARMSAEFYEPIHRSNLYDCLAALLQHSEKDLRGKTCTLIGNLCKHSDFFFEPLEKNHIVERLVKCCSDSDAQTQKLAAFAIGNAAFHSGYLYNLLSPAIPSLVGLLACGDAKTRQNAAGALSNFVRNGDQLVSSLAESSVVESLLKMLRDDDTPSSKKVAVLTINSFCAYDVFRRKFIALNLREDIRKLQQDPNARADPSIQKYVGNLVDRLG
3MWU Chain:A ((22-307))-----ERYNIVCMLGKGSFGEVLKCKDRITQQEYAVKVINKASAKNKDTSTILREVELLKKLDHPNIMKLFEILEDSSSFYIVGELYTGGELFDEIIKRKRFSEHDAARIIKQVFSGITYMHKHNIVHRDLKPENILLESKEKDCDIKIIDFGLSTCFQQN----DRI-GTAYYIAPEVLR-GTYDEKCDVWSAGVILYILLSGTPPFYGKNEYDILKRVETGKYAFDLPQWRTISDDAKDLIRKMLTFHPSLRITATQCLEHPWIQKYSSET-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 3MWU.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1265 -52885 -41.81 -204.98
target 2D structure prediction score : 0.74
Monomeric hydrophicity matching model chain A : 0.57

3D Compatibility (PKB) : -41.81
2D Compatibility (Sec. Struct. Predict.) : 0.74
1D Compatibility (Hydrophobicity) : 0.57
QMean score : 0.522

(partial model without unconserved sides chains):
PDB file : Tito_3MWU.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3MWU-query.scw
PDB file : Tito_Scwrl_3MWU.pdb: